4-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]cyclohexane-1-carboxylic acid

C16H20N2O2 — CID 172581833

IUPAC4-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]cyclohexane-1-carboxylic acid
SMILESCc1cn2cc(CC3CCC(C(=O)O)CC3)ccc2n1
InChIInChI=1S/C16H20N2O2/c1-11-9-18-10-13(4-7-15(18)17-11)8-12-2-5-14(6-3-12)16(19)20/h4,7,9-10,12,14H,2-3,5-6,8H2,1H3,(H,19,20)
InChIKeyCMLVLMKFUAVVLB-UHFFFAOYSA-N
MW272.35 g/mol
LogP3.08
Rot. Bonds3

About 4-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]cyclohexane-1-carboxylic acid

4-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]cyclohexane-1-carboxylic acid (PubChem CID 172581833) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 4-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]cyclohexane-1-carboxylic acid.

Molecular Properties

Compound Name4-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]cyclohexane-1-carboxylic acid
PubChem CID172581833
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name4-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]cyclohexane-1-carboxylic acid
SMILESCc1cn2cc(CC3CCC(C(=O)O)CC3)ccc2n1
InChIInChI=1S/C16H20N2O2/c1-11-9-18-10-13(4-7-15(18)17-11)8-12-2-5-14(6-3-12)16(19)20/h4,7,9-10,12,14H,2-3,5-6,8H2,1H3,(H,19,20)
InChIKeyCMLVLMKFUAVVLB-UHFFFAOYSA-N
XLogP3.08
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methylimidazo[1,2-a]pyridin-6-yl)butan-2-one
CID 14348763
methyl 4-[(3-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)methyl]cyclohexane-1-carboxylate
CID 172581583
2-methyl-6-(2-methylpropyl)imidazo[1,2-a]pyridine
CID 118488947
4-[(8-chloro-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)methyl]cyclohexane-1-carboxylic acid
CID 172581585
4-(pyridin-3-ylmethyl)cyclohexane-1-carboxylic acid
CID 83822125
4-[(1,3-dimethylpyrazolo[4,5-b]pyridin-6-yl)methyl]cyclohexane-1-carboxylic acid
CID 172582159
4-[(2-methyl-1,3-thiazol-4-yl)methyl]cyclohexane-1-carboxylic acid
CID 172582162
N-cyclopentyl-2-methylimidazo[1,2-a]pyridine-6-carboxamide
CID 110704148
(2-methylimidazo[1,2-a]pyridin-6-yl)-(4-methylpiperidin-1-yl)methanone
CID 110704151
1-(cyclopropylmethyl)-4-methylbenzene
CID 3282669
2-(2-fluorophenyl)-N-(2-methylimidazo[1,2-a]pyridin-6-yl)acetamide
CID 110734846
4-[(4-methylphenyl)methylcarbamoyl]cyclohexane-1-carboxylic acid
CID 63784141

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]cyclohexane-1-carboxylic acid?
The IUPAC name of 4-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]cyclohexane-1-carboxylic acid (CID 172581833) is 4-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]cyclohexane-1-carboxylic acid.
What is the SMILES notation for 4-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]cyclohexane-1-carboxylic acid?
The canonical SMILES for 4-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]cyclohexane-1-carboxylic acid is Cc1cn2cc(CC3CCC(C(=O)O)CC3)ccc2n1.
What is the InChIKey of 4-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]cyclohexane-1-carboxylic acid?
The InChIKey is CMLVLMKFUAVVLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-11-9-18-10-13(4-7-15(18)17-11)8-12-2-5-14(6-3-12)16(19)20/h4,7,9-10,12,14H,2-3,5-6,8H2,1H3,(H,19,20).
What are the key properties of 4-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]cyclohexane-1-carboxylic acid?
4-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]cyclohexane-1-carboxylic acid has a molecular weight of 272.35 g/mol, XLogP of 3.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methylimidazo[1,2-a]pyridin-6-yl)methyl]cyclohexane-1-carboxylic acid is sourced from PubChem (CID 172581833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).